trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane

C15H33BO2SiSn — CID 46704033

IUPACtrimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane
SMILESCC1(C)OB(/C=C(/C[Si](C)(C)C)[Sn](C)(C)C)OC1(C)C
InChIInChI=1S/C12H24BO2Si.3CH3.Sn/c1-11(2)12(3,4)15-13(14-11)9-8-10-16(5,6)7;;;;/h9H,10H2,1-7H3;3*1H3;
InChIKeyUBRUMXNIHDPHDL-UHFFFAOYSA-N
MW403.04 g/mol
LogP4.76
Rot. Bonds4

About trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane

trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane (PubChem CID 46704033) has the molecular formula C15H33BO2SiSn and a molecular weight of 403.04 g/mol. Its IUPAC name is trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane.

Molecular Properties

Compound Nametrimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane
PubChem CID46704033
Molecular FormulaC15H33BO2SiSn
Molecular Weight403.04 g/mol
Exact Mass404.14
IUPAC Nametrimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane
SMILESCC1(C)OB(/C=C(/C[Si](C)(C)C)[Sn](C)(C)C)OC1(C)C
InChIInChI=1S/C12H24BO2Si.3CH3.Sn/c1-11(2)12(3,4)15-13(14-11)9-8-10-16(5,6)7;;;;/h9H,10H2,1-7H3;3*1H3;
InChIKeyUBRUMXNIHDPHDL-UHFFFAOYSA-N
XLogP4.76
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.04
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane?
The IUPAC name of trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane (CID 46704033) is trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane.
What is the SMILES notation for trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane?
The canonical SMILES for trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane is CC1(C)OB(/C=C(/C[Si](C)(C)C)[Sn](C)(C)C)OC1(C)C.
What is the InChIKey of trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane?
The InChIKey is UBRUMXNIHDPHDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24BO2Si.3CH3.Sn/c1-11(2)12(3,4)15-13(14-11)9-8-10-16(5,6)7;;;;/h9H,10H2,1-7H3;3*1H3;.
What are the key properties of trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane?
trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane has a molecular weight of 403.04 g/mol, XLogP of 4.76, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylstannylprop-2-enyl]silane is sourced from PubChem (CID 46704033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).